N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide

C22H22N2O3S — CID 24671719

IUPACN-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide
SMILESCN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C22H22N2O3S/c1-24(2)28(26,27)21-10-6-9-20(16-21)23-22(25)15-17-11-13-19(14-12-17)18-7-4-3-5-8-18/h3-14,16H,15H2,1-2H3,(H,23,25)
InChIKeyOQBZZKXXRUJYPR-UHFFFAOYSA-N
MW394.50 g/mol
LogP3.79
Rot. Bonds6

About N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide

N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide (PubChem CID 24671719) has the molecular formula C22H22N2O3S and a molecular weight of 394.50 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide
PubChem CID24671719
Molecular FormulaC22H22N2O3S
Molecular Weight394.50 g/mol
Exact Mass394.14
IUPAC NameN-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide
SMILESCN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C22H22N2O3S/c1-24(2)28(26,27)21-10-6-9-20(16-21)23-22(25)15-17-11-13-19(14-12-17)18-7-4-3-5-8-18/h3-14,16H,15H2,1-2H3,(H,23,25)
InChIKeyOQBZZKXXRUJYPR-UHFFFAOYSA-N
XLogP3.79
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.50
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-N-(4-sulfamoylphenyl)acetamide
CID 729977
N-(4-(Aminosulfonyl)phenyl)-4-tert-butylbenzamide
CID 315810
4-tert-butyl-N-(3-sulfamoylphenyl)benzamide
CID 2812911
N-{5-[(dimethylamino)sulfonyl]-2-methylphenyl}-3-phenylpropanamide
CID 2812928
N-Phenyl-3-(1-piperidinylsulfonyl)benzamide
CID 558837
4-tert-butyl-N-(2-sulfamoylphenyl)benzamide
CID 11573504
Sulfonamide deriv., 7d
CID 44520901
3-[[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]amino]benzenesulfonamide
CID 168269012
4-methyl-N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]benzamide
CID 738960
N-(2-methylphenyl)-2-[methyl(phenylsulfonyl)amino]benzamide
CID 1006749
N-(3-acetamidophenyl)-4-[ethyl(phenyl)sulfamoyl]benzamide
CID 2482626
N-{5-[(dimethylamino)sulfonyl]-2-methylphenyl}cyclohexanecarboxamide
CID 2812913

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide (CID 24671719) is N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide is CN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)c1.
What is the InChIKey of N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide?
The InChIKey is OQBZZKXXRUJYPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3S/c1-24(2)28(26,27)21-10-6-9-20(16-21)23-22(25)15-17-11-13-19(14-12-17)18-7-4-3-5-8-18/h3-14,16H,15H2,1-2H3,(H,23,25).
What are the key properties of N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide?
N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide has a molecular weight of 394.50 g/mol, XLogP of 3.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)phenyl]-2-(4-phenylphenyl)acetamide is sourced from PubChem (CID 24671719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).